N-(2-amino-4,6-dichlorophenyl)-2-(dimethylamino)acetamide

C10H13Cl2N3O — CID 16789822

IUPACN-(2-amino-4,6-dichlorophenyl)-2-(dimethylamino)acetamide
SMILESCN(C)CC(=O)Nc1c(N)cc(Cl)cc1Cl
InChIInChI=1S/C10H13Cl2N3O/c1-15(2)5-9(16)14-10-7(12)3-6(11)4-8(10)13/h3-4H,5,13H2,1-2H3,(H,14,16)
InChIKeyXXZPBRHYWOLZIA-UHFFFAOYSA-N
MW262.14 g/mol
LogP2.08
Rot. Bonds3

About N-(2-amino-4,6-dichlorophenyl)-2-(dimethylamino)acetamide

N-(2-amino-4,6-dichlorophenyl)-2-(dimethylamino)acetamide (PubChem CID 16789822) has the molecular formula C10H13Cl2N3O and a molecular weight of 262.14 g/mol. Its IUPAC name is N-(2-amino-4,6-dichlorophenyl)-2-(dimethylamino)acetamide.

Molecular Properties

Compound NameN-(2-amino-4,6-dichlorophenyl)-2-(dimethylamino)acetamide
PubChem CID16789822
Molecular FormulaC10H13Cl2N3O
Molecular Weight262.14 g/mol
Exact Mass261.04
IUPAC NameN-(2-amino-4,6-dichlorophenyl)-2-(dimethylamino)acetamide
SMILESCN(C)CC(=O)Nc1c(N)cc(Cl)cc1Cl
InChIInChI=1S/C10H13Cl2N3O/c1-15(2)5-9(16)14-10-7(12)3-6(11)4-8(10)13/h3-4H,5,13H2,1-2H3,(H,14,16)
InChIKeyXXZPBRHYWOLZIA-UHFFFAOYSA-N
XLogP2.08
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.14
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(2-amino-4,6-dichlorophenyl)-2-[methyl(2-methylbutyl)amino]acetamide
CID 43295373
2-[[2-(2-amino-4,6-dichloroanilino)-2-oxoethyl]-ethylamino]acetamide
CID 103101399
N-(2-amino-4,6-dichlorophenyl)-2-[cyclopentyl(ethyl)amino]acetamide
CID 43540670
N-(2-amino-4,6-dichlorophenyl)-2-[methyl(oxolan-2-ylmethyl)amino]acetamide
CID 61431452
N-(2-amino-4,6-dichlorophenyl)-3-[(2-hydroxy-2-methylpropyl)-methylamino]propanamide
CID 79380076
N-(2-amino-4,6-dichlorophenyl)-2-tert-butylsulfinylacetamide
CID 61304232
2-[2-hydroxyethyl(methyl)amino]-N-(2,4,6-trichlorophenyl)acetamide
CID 60683836
N-(2-amino-4,6-dichlorophenyl)-4-[2-methoxyethyl(methyl)amino]butanamide
CID 61428718
N-(2-amino-4,6-dichlorophenyl)-3-propylsulfanylpropanamide
CID 29292059
methyl 2-[2-(2-amino-4,6-dichloroanilino)-2-oxoethyl]sulfanylacetate
CID 43617977
ethyl 2-[methyl-[2-oxo-2-(2,4,6-trichloroanilino)ethyl]amino]acetate
CID 62013363
N-(2-amino-4,6-dichlorophenyl)-4-propylsulfanylbutanamide
CID 29043327

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4,6-dichlorophenyl)-2-(dimethylamino)acetamide?
The IUPAC name of N-(2-amino-4,6-dichlorophenyl)-2-(dimethylamino)acetamide (CID 16789822) is N-(2-amino-4,6-dichlorophenyl)-2-(dimethylamino)acetamide.
What is the SMILES notation for N-(2-amino-4,6-dichlorophenyl)-2-(dimethylamino)acetamide?
The canonical SMILES for N-(2-amino-4,6-dichlorophenyl)-2-(dimethylamino)acetamide is CN(C)CC(=O)Nc1c(N)cc(Cl)cc1Cl.
What is the InChIKey of N-(2-amino-4,6-dichlorophenyl)-2-(dimethylamino)acetamide?
The InChIKey is XXZPBRHYWOLZIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13Cl2N3O/c1-15(2)5-9(16)14-10-7(12)3-6(11)4-8(10)13/h3-4H,5,13H2,1-2H3,(H,14,16).
What are the key properties of N-(2-amino-4,6-dichlorophenyl)-2-(dimethylamino)acetamide?
N-(2-amino-4,6-dichlorophenyl)-2-(dimethylamino)acetamide has a molecular weight of 262.14 g/mol, XLogP of 2.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4,6-dichlorophenyl)-2-(dimethylamino)acetamide is sourced from PubChem (CID 16789822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).